(5-methyl-2-propan-2-yl-phenyl) 2-(3-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 2-(3-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: (2-isopropyl-5-methyl-phenyl) 2-(3-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(3-methoxyphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 2-(3-methoxyphenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(3-methoxyphenyl)-6,8-dimethyl-cinchoninic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)OC

InChI

InChI=1S/C29H29NO3/c1-17(2)23-11-10-18(3)14-27(23)33-29(31)25-16-26(21-8-7-9-22(15-21)32-6)30-28-20(5)12-19(4)13-24(25)28/h7-17H,1-6H3